1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one

C9H15N5OS — CID 62492044

IUPAC1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one
SMILESCCNc1snnc1CN1CCN(C)C1=O
InChIInChI=1S/C9H15N5OS/c1-3-10-8-7(11-12-16-8)6-14-5-4-13(2)9(14)15/h10H,3-6H2,1-2H3
InChIKeyXNNJHMQZBXOYDG-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.84
Rot. Bonds4

About 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one

1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one (PubChem CID 62492044) has the molecular formula C9H15N5OS and a molecular weight of 241.32 g/mol. Its IUPAC name is 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one
PubChem CID62492044
Molecular FormulaC9H15N5OS
Molecular Weight241.32 g/mol
Exact Mass241.10
IUPAC Name1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one
SMILESCCNc1snnc1CN1CCN(C)C1=O
InChIInChI=1S/C9H15N5OS/c1-3-10-8-7(11-12-16-8)6-14-5-4-13(2)9(14)15/h10H,3-6H2,1-2H3
InChIKeyXNNJHMQZBXOYDG-UHFFFAOYSA-N
XLogP0.84
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one?
The IUPAC name of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one (CID 62492044) is 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one?
The canonical SMILES for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one is CCNc1snnc1CN1CCN(C)C1=O.
What is the InChIKey of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one?
The InChIKey is XNNJHMQZBXOYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5OS/c1-3-10-8-7(11-12-16-8)6-14-5-4-13(2)9(14)15/h10H,3-6H2,1-2H3.
What are the key properties of 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one?
1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one has a molecular weight of 241.32 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(ethylamino)thiadiazol-4-yl]methyl]-3-methylimidazolidin-2-one is sourced from PubChem (CID 62492044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).